TL;DR: Bis(beta-(p-phenylazophenoxy)ethyl) sulfide (CAS 63979-96-4) is a chemical compound with molecular formula C28H26N4O2S and molecular weight 482.17764 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
phenyl-[4-[2-[2-(4-phenyldiazenylphenoxy)ethylsulfanyl]ethoxy]phenyl]diazene
Also Known As: Dansyltriglycine, Dansyl-gly-gly-gly, Bis[2- ethyl]sulfide, Sulfide, bis(2-(p-phenylazophenoxy)ethyl), Bis(beta-(p-phenylazophenoxy)ethyl) sulfide
| Molecular Formula | C28H26N4O2S |
| Molecular Weight | 482.17764 g/mol |
| XLogP | 7.8 |
| Topological Polar Surface Area (TPSA) | 93.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 12 |
| Exact Mass | 482.17764 Da |
| Heavy Atoms | 35 |
| Complexity | 554.0 |
| SMILES | C1=CC=C(C=C1)N=NC2=CC=C(C=C2)OCCSCCOC3=CC=C(C=C3)N=NC4=CC=CC=C4 |
| InChIKey | WCVJRTNKZUMYMY-UHFFFAOYSA-N |
The XLogP value of 7.8 indicates that Bis(beta-(p-phenylazophenoxy)ethyl) sulfide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Bis(beta-(p-phenylazophenoxy)ethyl) sulfide. Following Lipinski's Rule of Five, Bis(beta-(p-phenylazophenoxy)ethyl) sulfide has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Bis(beta-(p-phenylazophenoxy)ethyl) sulfide is 63979-96-4.
The molecular formula of Bis(beta-(p-phenylazophenoxy)ethyl) sulfide is C28H26N4O2S.
The molecular weight of Bis(beta-(p-phenylazophenoxy)ethyl) sulfide is 482.17764 g/mol.
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